N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C21H23N5O2 — CID 109068010

IUPACN-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)cc1
InChIInChI=1S/C21H23N5O2/c1-24(2)16-10-8-15(9-11-16)22-20(27)19-23-18(17-7-3-4-14-26(17)19)21(28)25-12-5-6-13-25/h3-4,7-11,14H,5-6,12-13H2,1-2H3,(H,22,27)
InChIKeyYFCHLVQFNDHMCE-UHFFFAOYSA-N
MW377.45 g/mol
LogP2.89
Rot. Bonds4

About N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109068010) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109068010
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC NameN-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)cc1
InChIInChI=1S/C21H23N5O2/c1-24(2)16-10-8-15(9-11-16)22-20(27)19-23-18(17-7-3-4-14-26(17)19)21(28)25-12-5-6-13-25/h3-4,7-11,14H,5-6,12-13H2,1-2H3,(H,22,27)
InChIKeyYFCHLVQFNDHMCE-UHFFFAOYSA-N
XLogP2.89
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(3,4-dimethylphenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109067964
1-N-tert-butyl-3-N-[4-(dimethylamino)phenyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071118
1-(4-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-3-carboxamide
CID 109068726
1-(piperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066328
3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071776
N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068018
N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109074186
N-(5-methyl-1,2-oxazol-3-yl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068024
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
1-(piperidine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066963
1-(azepane-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109067029
1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
CID 109071234

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109068010) is N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is CN(C)c1ccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)cc1.
What is the InChIKey of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is YFCHLVQFNDHMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-24(2)16-10-8-15(9-11-16)22-20(27)19-23-18(17-7-3-4-14-26(17)19)21(28)25-12-5-6-13-25/h3-4,7-11,14H,5-6,12-13H2,1-2H3,(H,22,27).
What are the key properties of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109068010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).